3,5,7-tris(methoxymethoxycarbonyl)adamantane-1-carboxylic acid

Systemtic Name: 3,5,7-tris(methoxymethoxycarbonyl)adamantane-1-carboxylic acid Openeye Name: 3,5,7-tris(methoxymethoxycarbonyl)adamantane-1-carboxylic acid CAS Name: 3,5,7-tris[methoxymethoxy(oxo)methyl]-1-adamantanecarboxylic acid IUPAC Name: 3,5,7-tris(methoxymethoxycarbonyl)adamantane-1-carboxylic acid Traditional Name: 3,5,7-tris(methoxymethoxycarbonyl)adamantane-1-carboxylic acid Formula: C20H28O11 MolecularWeight: 444.42972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCOC(=O)C12CC3(CC(C1)(CC(C3)(C2)C(=O)OCOC)C(=O)OCOC)C(=O)O

Isomeric SMILES

COCOC(=O)C12CC3(CC(C1)(CC(C3)(C2)C(=O)OCOC)C(=O)OCOC)C(=O)O

InChI

InChI=1S/C20H28O11/c1-26-10-29-14(23)18-4-17(13(21)22)5-19(7-18,15(24)30-11-27-2)9-20(6-17,8-18)16(25)31-12-28-3/h4-12H2,1-3H3,(H,21,22)